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4-sulfo-5-(4-sulfophenyl)naphthalene-2,7-dicarboxylic acid

4-sulfo-5-(4-sulfophenyl)naphthalene-2,7-dicarboxylic acid

Systemtic Name:4-sulfo-5-(4-sulfophenyl)naphthalene-2,7-dicarboxylic acid
Openeye Name:4-sulfo-5-(4-sulfophenyl)naphthalene-2,7-dicarboxylic acid
CAS Name:4-sulfo-5-(4-sulfophenyl)naphthalene-2,7-dicarboxylic acid
IUPAC Name:4-sulfo-5-(4-sulfophenyl)naphthalene-2,7-dicarboxylic acid
Traditional Name:4-sulfo-5-(4-sulfophenyl)naphthalene-2,7-dicarboxylic acid
Formula: C18H12O10S2
MolecularWeight: 452.41188
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C(=CC(=C2)C(=O)O)C=C(C=C3S(=O)(=O)O)C(=O)O)S(=O)(=O)O


Isomeric SMILES

C1=CC(=CC=C1C2=C3C(=CC(=C2)C(=O)O)C=C(C=C3S(=O)(=O)O)C(=O)O)S(=O)(=O)O


InChI

InChI=1S/C18H12O10S2/c19-17(20)11-5-10-6-12(18(21)22)8-15(30(26,27)28)16(10)14(7-11)9-1-3-13(4-2-9)29(23,24)25/h1-8H,(H,19,20)(H,21,22)(H,23,24,25)(H,26,27,28)


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